N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[(2-methylcyclopropyl)carbonylamino]benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[(2-methylcyclopropyl)carbonylamino]benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[(2-methylcyclopropanecarbonyl)amino]benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-[[(2-methylcyclopropyl)-oxomethyl]amino]benzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[(2-methylcyclopropanecarbonyl)amino]benzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-4-[(2-methylcyclopropanecarbonyl)amino]benzamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)NC2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CC1CC1C(=O)NC2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C22H23N3O2S/c1-15-12-20(15)22(27)25-19-8-6-16(7-9-19)21(26)24-10-11-28-14-18-5-3-2-4-17(18)13-23/h2-9,15,20H,10-12,14H2,1H3,(H,24,26)(H,25,27)